Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p28_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A NE1 ASP 161.A OD1 no hydrogen 3.022 N/A THR 7.A N PRO 4.A O no hydrogen 3.060 N/A THR 7.A OG1 PRO 4.A O no hydrogen 2.696 N/A THR 7.A OG1 TYR 51.A OH no hydrogen 2.849 N/A LEU 8.A N TRP 5.A O no hydrogen 2.987 N/A VAL 9.A N PRO 6.A O no hydrogen 3.285 N/A THR 10.A OG1 HIS 126.A NE2 no hydrogen 2.816 N/A PHE 12.A N LEU 8.A O no hydrogen 2.943 N/A PHE 16.A N VAL 13.A O no hydrogen 3.023 N/A SER 17.A N GLN 14.A O no hydrogen 3.134 N/A SER 17.A OG GLN 14.A O no hydrogen 2.614 N/A ARG 18.A N VAL 169.A O no hydrogen 2.821 N/A TYR 19.A OH HIS 144.A NE2 no hydrogen 2.807 N/A HIS 22.A NE2 ILE 174.A O no hydrogen 2.774 N/A MET 23.A N PRO 20.A O no hydrogen 2.816 N/A LYS 24.A N ASP 21.A O no hydrogen 3.306 N/A LYS 24.A NZ TYR 19.A O no hydrogen 2.730 N/A ARG 25.A NH1 HIS 182.A O no hydrogen 3.118 N/A HIS 26.A N MET 23.A O no hydrogen 2.874 N/A ASP 27.A N LYS 24.A O no hydrogen 3.249 N/A PHE 28.A N HIS 26.A O no hydrogen 3.074 N/A LYS 30.A N ASP 27.A OD1 no hydrogen 3.214 N/A LYS 30.A NZ CYS 15.A O no hydrogen 2.864 N/A LYS 30.A NZ SER 17.A O no hydrogen 2.709 N/A LYS 30.A NZ ASP 27.A OD2 no hydrogen 2.744 N/A SER 31.A N ASP 27.A O no hydrogen 3.383 N/A SER 31.A OG PHE 28.A O no hydrogen 2.855 N/A ALA 32.A N PHE 28.A O no hydrogen 3.155 N/A MET 33.A N LYS 30.A O no hydrogen 3.088 N/A GLU 35.A N GLU 35.A OE1 no hydrogen 2.849 N/A GLY 36.A N ALA 32.A O no hydrogen 2.757 N/A TYR 37.A N VAL 57.A O no hydrogen 3.028 N/A VAL 38.A N THR 131.A O no hydrogen 2.786 N/A GLN 39.A N ALA 55.A O no hydrogen 2.872 N/A GLU 40.A N GLN 129.A O no hydrogen 2.779 N/A ARG 41.A N THR 53.A O no hydrogen 3.051 N/A ARG 41.A NE GLN 128.A OE1 no hydrogen 3.006 N/A ARG 41.A NH1 THR 10.A O no hydrogen 2.839 N/A ARG 41.A NH2 GLN 128.A OE1 no hydrogen 2.837 N/A THR 42.A N TYR 127.A O no hydrogen 3.090 N/A ILE 43.A N TYR 51.A O no hydrogen 2.842 N/A SER 44.A N ASP 125.A O no hydrogen 2.790 N/A PHE 45.A N GLY 49.A O no hydrogen 3.009 N/A LYS 46.A N LEU 123.A O no hydrogen 2.968 N/A LYS 46.A NZ ASP 47.A OD2 no hydrogen 3.049 N/A ASP 48.A N PHE 45.A O no hydrogen 2.980 N/A GLY 49.A N ASP 48.A OD1 no hydrogen 2.888 N/A ASN 50.A N ILE 73.A O no hydrogen 3.054 N/A TYR 51.A N ILE 43.A O no hydrogen 2.883 N/A TYR 51.A OH THR 7.A OG1 no hydrogen 2.849 N/A LYS 52.A N LYS 71.A O no hydrogen 2.926 N/A THR 53.A N ARG 41.A O no hydrogen 2.806 N/A ARG 54.A N GLU 69.A O no hydrogen 3.023 N/A ARG 54.A NH1 GLU 56.A OE2 no hydrogen 3.403 N/A ARG 54.A NH2 GLU 56.A OE2 no hydrogen 3.162 N/A ALA 55.A N GLN 39.A O no hydrogen 2.928 N/A GLU 56.A N ARG 67.A O no hydrogen 2.952 N/A VAL 57.A N TYR 37.A O no hydrogen 2.930 N/A LYS 58.A N VAL 65.A O no hydrogen 3.006 N/A PHE 59.A N PRO 34.A O no hydrogen 3.184 N/A GLU 60.A N THR 63.A O no hydrogen 2.739 N/A THR 63.A N GLU 60.A O no hydrogen 3.175 N/A THR 63.A OG1 ASP 62.A OD1 no hydrogen 2.930 N/A LEU 64.A N PRO 198.A O no hydrogen 3.020 N/A VAL 65.A N LYS 58.A O no hydrogen 2.916 N/A ASN 66.A N LEU 200.A O no hydrogen 2.888 N/A ASN 66.A ND2 THR 11.A O no hydrogen 3.527 N/A ASN 66.A ND2 PHE 12.A O no hydrogen 2.907 N/A ARG 67.A N GLU 56.A O no hydrogen 3.074 N/A ARG 67.A NE GLU 60.A OE2 no hydrogen 3.264 N/A ARG 67.A NH1 GLU 202.A OE1 no hydrogen 2.505 N/A ARG 67.A NH2 GLU 60.A OE1 no hydrogen 3.291 N/A ARG 67.A NH2 GLU 60.A OE2 no hydrogen 3.073 N/A ILE 68.A N GLU 202.A O no hydrogen 2.881 N/A GLU 69.A N ARG 54.A O no hydrogen 2.859 N/A LEU 70.A N ASP 204.A O no hydrogen 2.981 N/A LYS 71.A N LYS 52.A O no hydrogen 3.023 N/A GLY 72.A N ASP 206.A O no hydrogen 2.706 N/A ILE 73.A N ASN 50.A O no hydrogen 3.044 N/A PHE 75.A N ASN 208.A OD1 no hydrogen 3.096 N/A LYS 76.A N ASP 48.A OD1 no hydrogen 2.815 N/A GLY 79.A N LYS 76.A O no hydrogen 3.059 N/A GLY 83.A N GLY 79.A O no hydrogen 2.979 N/A HIS 84.A N ILE 81.A O no hydrogen 3.000 N/A HIS 84.A ND1 LEU 82.A O no hydrogen 3.249 N/A HIS 84.A NE2 LEU 1.A O no hydrogen 3.127 N/A LYS 85.A N ASN 80.A O no hydrogen 2.936 N/A LYS 85.A NZ ASP 78.A O no hydrogen 2.813 N/A GLU 87.A N ASN 115.A O no hydrogen 2.840 N/A TYR 88.A OH SER 153.A O no hydrogen 2.665 N/A ASN 89.A ND2 GLU 87.A OE1 no hydrogen 2.862 N/A HIS 93.A N THR 148.A O no hydrogen 3.176 N/A VAL 95.A N LEU 146.A O no hydrogen 2.864 N/A ILE 97.A N HIS 144.A O no hydrogen 2.869 N/A THR 98.A N LYS 107.A O no hydrogen 3.025 N/A ASP 100.A N GLY 105.A O no hydrogen 2.887 N/A LYS 103.A N ASP 100.A O no hydrogen 3.235 N/A LYS 103.A NZ ASP 100.A OD2 no hydrogen 2.195 N/A ASN 104.A N LYS 101.A O no hydrogen 3.180 N/A GLY 105.A N ASP 100.A O no hydrogen 3.111 N/A ILE 106.A N ASN 130.A O no hydrogen 3.154 N/A LYS 107.A N THR 98.A O no hydrogen 2.990 N/A LYS 107.A NZ THR 98.A OG1 no hydrogen 2.737 N/A LYS 107.A NZ ALA 99.A O no hydrogen 3.191 N/A ALA 108.A N GLN 128.A O no hydrogen 3.093 N/A PHE 110.A N HIS 126.A O no hydrogen 3.085 N/A ILE 112.A N ALA 124.A O no hydrogen 2.943 N/A HIS 114.A N GLN 122.A O no hydrogen 2.864 N/A ASN 115.A ND2 GLU 87.A OE1 no hydrogen 3.213 N/A ASN 115.A ND2 ASN 89.A OD1 no hydrogen 3.344 N/A ILE 116.A N SER 120.A O no hydrogen 2.952 N/A GLU 117.A N LYS 85.A O no hydrogen 2.758 N/A GLY 119.A N ILE 116.A O no hydrogen 3.123 N/A GLN 122.A N HIS 114.A O no hydrogen 2.775 N/A GLN 122.A NE2 LYS 46.A O no hydrogen 2.965 N/A GLN 122.A NE2 LEU 123.A O no hydrogen 3.038 N/A ALA 124.A N ILE 112.A O no hydrogen 2.853 N/A ASP 125.A N SER 44.A O no hydrogen 2.803 N/A HIS 126.A N PHE 110.A O no hydrogen 2.705 N/A HIS 126.A ND1 ALA 124.A O no hydrogen 2.857 N/A HIS 126.A NE2 THR 10.A OG1 no hydrogen 2.816 N/A TYR 127.A N THR 42.A O no hydrogen 2.935 N/A GLN 128.A N ALA 108.A O no hydrogen 2.815 N/A GLN 128.A NE2 GLN 14.A OE1 no hydrogen 3.030 N/A GLN 129.A N GLU 40.A O no hydrogen 2.823 N/A GLN 129.A NE2 GLU 40.A OE1 no hydrogen 3.289 N/A ASN 130.A N ILE 106.A O no hydrogen 2.771 N/A THR 131.A N VAL 38.A O no hydrogen 2.960 N/A ILE 133.A N GLY 36.A O no hydrogen 2.889 N/A LEU 139.A N SER 31.A OG no hydrogen 2.982 N/A ASP 142.A N HIS 26.A ND1 no hydrogen 3.010 N/A HIS 144.A N ILE 97.A O no hydrogen 3.302 N/A HIS 144.A ND1 ASP 142.A O no hydrogen 2.831 N/A HIS 144.A NE2 TYR 19.A OH no hydrogen 2.807 N/A TYR 145.A N ALA 172.A O no hydrogen 3.009 N/A LEU 146.A N VAL 95.A O no hydrogen 2.730 N/A SER 147.A N THR 170.A O no hydrogen 2.834 N/A SER 147.A OG.B ASN 94.A OD1 no hydrogen 2.865 N/A THR 148.A N HIS 93.A O no hydrogen 2.872 N/A THR 148.A OG1 LEU 146.A O no hydrogen 3.347 N/A GLN 149.A N PHE 168.A O no hydrogen 2.856 N/A SER 150.A OG GLU 167.A OE2 no hydrogen 2.624 N/A LYS 151.A N LEU 166.A O no hydrogen 2.791 N/A SER 153.A N VAL 164.A O no hydrogen 2.844 N/A LYS 154.A NZ HIS 162.A O no hydrogen 2.759 N/A ASP 155.A N HIS 162.A NE2 no hydrogen 2.849 N/A ASN 157.A N ASP 155.A OD1 no hydrogen 2.968 N/A GLU 158.A N ASP 155.A O no hydrogen 3.115 N/A ARG 160.A N GLU 158.A OE2 no hydrogen 3.057 N/A HIS 162.A ND1 ARG 160.A O no hydrogen 2.934 N/A MET 163.A N PHE 231.A O no hydrogen 3.012 N/A VAL 164.A N SER 153.A O no hydrogen 2.958 N/A LEU 165.A N LEU 229.A O no hydrogen 2.806 N/A LEU 166.A N LYS 151.A O no hydrogen 2.954 N/A GLU 167.A N LEU 227.A O no hydrogen 2.963 N/A PHE 168.A N GLN 149.A O no hydrogen 2.787 N/A VAL 169.A N GLY 225.A O no hydrogen 2.812 N/A THR 170.A N SER 147.A O no hydrogen 3.080 N/A ALA 171.A N ARG 18.A O no hydrogen 2.738 N/A ALA 172.A N TYR 145.A O no hydrogen 2.882 N/A SER 178.A N GLY 175.A O no hydrogen 3.143 N/A ARG 179.A NE ASP 142.A OD2 no hydrogen 3.069 N/A ARG 179.A NH2 ASP 142.A OD1 no hydrogen 2.803 N/A HIS 181.A N SER 178.A O no hydrogen 2.847 N/A HIS 182.A N ARG 179.A O no hydrogen 2.998 N/A HIS 182.A ND1 HIS 180.A O no hydrogen 3.149 N/A HIS 185.A ND1 HIS 183.A O no hydrogen 2.817 N/A HIS 185.A NE2 GLU 190.A OE1 no hydrogen 2.454 N/A LYS 188.A N SER 186.A OG no hydrogen 3.378 N/A GLU 191.A N ARG 187.A O no hydrogen 3.005 N/A LEU 192.A N GLY 189.A O no hydrogen 3.013 N/A PHE 193.A N GLU 190.A O no hydrogen 3.155 N/A THR 194.A OG1 GLU 191.A O no hydrogen 3.495 N/A VAL 197.A N GLY 220.A O no hydrogen 2.822 N/A ILE 199.A N GLY 218.A O no hydrogen 2.864 N/A LEU 200.A N LEU 64.A O no hydrogen 2.916 N/A VAL 201.A N GLY 216.A O no hydrogen 2.836 N/A GLU 202.A N ASN 66.A O no hydrogen 3.033 N/A LEU 203.A N VAL 214.A O no hydrogen 2.925 N/A ASP 204.A N ILE 68.A O no hydrogen 2.980 N/A GLY 205.A N PHE 212.A O no hydrogen 2.808 N/A ASP 206.A N LEU 70.A O no hydrogen 3.063 N/A VAL 207.A N HIS 210.A O no hydrogen 3.020 N/A ASN 208.A N GLY 72.A O no hydrogen 2.897 N/A ASN 208.A ND2 PHE 75.A O no hydrogen 2.976 N/A GLY 209.A N ASP 206.A OD1 no hydrogen 2.887 N/A HIS 210.A N VAL 207.A O no hydrogen 2.926 N/A PHE 212.A N GLY 205.A O no hydrogen 3.012 N/A SER 213.A OG ASP 204.A OD1 no hydrogen 2.934 N/A VAL 214.A N LEU 203.A O no hydrogen 2.984 N/A SER 215.A N ILE 232.A O no hydrogen 3.009 N/A GLY 216.A N VAL 201.A O no hydrogen 2.734 N/A GLU 217.A N LYS 230.A O no hydrogen 2.998 N/A GLY 218.A N ILE 199.A O no hydrogen 3.302 N/A GLU 219.A N THR 228.A O.A no hydrogen 2.990 N/A GLU 219.A N THR 228.A O.B no hydrogen 3.016 N/A GLY 220.A N VAL 197.A O no hydrogen 2.921 N/A ASP 221.A N LYS 226.A O no hydrogen 2.752 N/A THR 223.A OG1 THR 194.A O no hydrogen 3.251 N/A TYR 224.A N ASP 221.A O no hydrogen 3.072 N/A GLY 225.A N ALA 222.A O no hydrogen 3.024 N/A LYS 226.A N ASP 221.A O no hydrogen 3.148 N/A LEU 227.A N GLU 167.A O no hydrogen 2.991 N/A THR 228.A N.A GLU 219.A O no hydrogen 2.978 N/A THR 228.A N.B GLU 219.A O no hydrogen 2.989 N/A THR 228.A OG1.A GLU 219.A O no hydrogen 3.224 N/A LEU 229.A N LEU 165.A O no hydrogen 2.972 N/A LYS 230.A N GLU 217.A O no hydrogen 2.901 N/A LYS 230.A NZ ASP 155.A OD2 no hydrogen 2.779 N/A LYS 230.A NZ GLU 158.A OE1 no hydrogen 2.907 N/A PHE 231.A N MET 163.A O no hydrogen 2.782 N/A ILE 232.A N SER 215.A O no hydrogen 2.827 N/A CYS 233.A N ASP 161.A O no hydrogen 3.331 N/A CYS 233.A SG.A SER 213.A O no hydrogen 3.743 N/A CYS 233.A SG.B ASP 161.A O no hydrogen 3.955 N/A CYS 233.A SG.B ASP 161.A OD2 no hydrogen 3.827 N/A THR 234.A N SER 213.A O no hydrogen 3.063 N/A